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CS-W001157 4
Total: USD 88.00

4-Cyanophenyl 4-(trans-4-pentylcyclohexyl)benzoate

  • CAS No. 72928-55-3

  • Cat. No. CS-0152356
  • Molecule weight375.50
  • Purity≥97%
  • MDL No.MFCD09750946

*For research and further manufacturing use only, not for direct human use.

4-Cyanophenyl 4-(trans-4-pentylcyclohexyl)benzoate|CS-0152356

Structure of 72928-55-3

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General Information

  • CAS No. 72928-55-3
  • Cat. No. CS-0152356
  • Purity ≥97%
  • MDL No. MFCD09750946
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₅H₂₉NO₂
  • Molecular Weight 375.50
  • Synonym(s) p-cyanophenyl trans-p-(4-pentylcyclohexyl)benzoate
  • SMILES CCCCC[C@H]1CC[C@@H](CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N

Synthesis

  • Route1
    • 4-Cyanophenol Febuxostat Impurity|CS-0213981
      767-00-0
    • null|null
      73011-79-7
    • ~66%
    • 4-Cyanophenyl 4-(trans-4-pentylcyclohexyl)benzoate|CS-0152356
      72928-55-3

    References

    • Bezborodov, V. S.; Bubel', O. N.; Konovalov, V. A.; Ptashnikov, Yu. L. Journal of Organic Chemistry USSR (English Translation), 1983 , vol. 19, p. 1479 - 1483 Zhurnal Organicheskoi Khimii, 1983 , vol. 19, # 8 p. 1669 - 1674
  • Route2

    References

    • Journal of Organic Chemistry USSR (English Translation), , vol. 19, p. 1479 - 1483 Zhurnal Organicheskoi Khimii, , vol. 19, # 8 p. 1669 - 1674
  • Route3
    • null|null
      78531-55-2
    • ~%
    • 4-Cyanophenyl 4-(trans-4-pentylcyclohexyl)benzoate|CS-0152356
      72928-55-3

    References

    • Journal of Organic Chemistry USSR (English Translation), , vol. 19, p. 1479 - 1483 Zhurnal Organicheskoi Khimii, , vol. 19, # 8 p. 1669 - 1674

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.09
  • LogP   6.63158
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   7

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